SCHEMBL24251368

SCHEMBL24251368

C=C(C)c1c(C(=O)N[C@H]2CCc3ccccc32)ccc2c(-c3cccc(Cl)c3)c(C)nn12

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 8/20 0.45
▸ TAS1R1 Q7RTX1 8/20 0.45
▸ TAS1R2 Q8TE23 7/20 0.45
▸ CNR1 P21554 1/20 0.43
▸ PDE2A O00408 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ RIPK1 Q13546 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ CRHBP P24387 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40
▸ SPR P35270 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24251369 0.87 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2CNR1PDE2A
SCHEMBL24251441 0.85 PDE2A (0.42) TAS1R3TAS1R1TAS1R2PDE2AALDH1A1
SCHEMBL24251351 0.84 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2PDE2AALDH1A1
SCHEMBL24251432 0.82 BRD4 (0.40) TAS1R3TAS1R1TAS1R2CNR1CNR2
SCHEMBL24251444 0.82 TAS1R3 (0.44) TAS1R3TAS1R1TAS1R2CNR1PDE2A
SCHEMBL24251362 0.76 BRD4 (0.40) TAS1R3TAS1R1TAS1R2
SCHEMBL24251415 0.74 TAS1R3 (0.46) TAS1R3TAS1R1TAS1R2CNR1PDE2A
SCHEMBL24251365 0.73 P2RX7 (0.40) TAS1R3TAS1R1TAS1R2CNR1CNR2
SCHEMBL24251374 0.72 TAS1R3 (0.49) TAS1R3TAS1R1TAS1R2CNR1PDE2A
SCHEMBL24251353 0.71 BRD4 (0.42) TAS1R3TAS1R1TAS1R2CNR1CNR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220048903-A1 Anthelminthic Heterocyclic Compounds BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 2022-02-17 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220048903-A1 Anthelminthic Heterocyclic Compounds SDHA, PAH, PIGS TAS1R3 4103/4885TAS1R1 3604/4885TAS1R2 3646/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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